Geometry & MOs

Info

ID:	48621
PubChem CID:	11110083
Reduced:	O2C21H38 (1)
Stoich.:	A2B21C38 (1)
Weight, g/mol:	323.173273
ΔH_f, kcal/mol:	-124.76
Dipole, Da:	3.09
IP(EA), eV:	-9.37(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (3R)-5-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Drug info:

PubChemData

Smile

CCCC/C=C/CC/C=C\CCCCCCOC1CCCCO1

DOS

IR

Vibrations